Cell Reactant:
Thiol:disulfide interchange protein (DsbA)
Syringe Reactant:
BDBM231640
Meas. Tech.:
Enzyme Inhibition
Entry Date.:
06/06/17
ΔG°:
-5.37±n/a (kcal/mole)
pH:
7.4±0
Temperature:
298.15±0 (K)
ΔH° :
-6.94±1.41 (kJ/mole)
ΔS° :
-0.01±0 (kJ/mole-K)
Comments:
Mixed (oxidized & reduced) AbDsbA
Citation
 Premkumar, LKurth, FDuprez, WGrøftehauge, MKKing, GJHalili, MAHeras, BMartin, JL Structure of the Acinetobacter baumannii dithiol oxidase DsbA bound to elongation factor EF-Tu reveals a novel protein interaction site. J Biol Chem 289:19869-80 (2014) [PubMed]  Article 
Cell React
Name:
Thiol:disulfide interchange protein [27-205]
Synonyms:
F0KIP0_ACICP | Thiol:disulfide interchange protein (DsbA) | dsbA
Type:
Protein
Mol. Mass.:
20389.27
Organism:
Acinetobacter baumannii (AYE strain)
Description:
A. baumannii DsbA lacking the predicted periplasmic leader sequence (27-205 aa)
Residue:
179
Sequence:
AGKDYTVIANPGKVEVPGKIEVREFFWYGCPHCFKLEPHMQTWLKQIPKDVRFVRTPAAMNKMWEQGARTYYTSEALGVRKRTHLPLFHAIQVNGQQIFDQASAAKFFTRYGVPEQKFNSTYNSFAVTAKVAESNKLAQQYQLTGVPAVVVNGKYVVQGEDGKVTQVLNYLIEKERKAK
  
Syringe React
Name:
BDBM231640
Synonyms:
DYSQIDSAPEE
Type:
Small organic molecule
Emp. Form.:
C52H76N12O24
Mol. Mass.:
1253.2258
SMILES:
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
Structure:
Search PDB for entries with ligand similarity: